Cas no 1856-74-2 (Ethanone, 1-(6,6-dimethylbicyclo[3.1.0]hex-3-yl)-)
1856-74-2 structure
Product Name:Ethanone, 1-(6,6-dimethylbicyclo[3.1.0]hex-3-yl)-
CAS No:1856-74-2
MF:C10H16O
MW:152.233443260193
CID:1379636
PubChem ID:13148711
Update Time:2025-04-20
Ethanone, 1-(6,6-dimethylbicyclo[3.1.0]hex-3-yl)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 1-(6,6-dimethylbicyclo[3.1.0]hex-3-yl)-
- 1-(6,6-dimethyl-3-bicyclo[3.1.0]hexanyl)ethanone
- AKOS040802621
- 1-(6,6-Dimethylbicyclo[3.1.0]hexan-3-yl)ethan-1-one
- 3-acetyl-6,6-dimethylbicyclo[3.1.0]hexane
- DTXSID10522102
- 1856-74-2
- 1-{6,6-dimethylbicyclo[3.1.0]hexan-3-yl}ethan-1-one
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- Inchi: 1S/C10H16O/c1-6(11)7-4-8-9(5-7)10(8,2)3/h7-9H,4-5H2,1-3H3
- InChI Key: AEJVFGYEZXMAPQ-UHFFFAOYSA-N
- SMILES: O=C(C)C1CC2C(C)(C)C2C1
Computed Properties
- Exact Mass: 152.12018
- Monoisotopic Mass: 152.120115130g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 191
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.9
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
Ethanone, 1-(6,6-dimethylbicyclo[3.1.0]hex-3-yl)- Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
1856-74-2 (Ethanone, 1-(6,6-dimethylbicyclo[3.1.0]hex-3-yl)-) Related Products
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